(4E)-2-(2-bromophenyl)-4-[(Z)-2-methyl-3-phenylprop-2-enylidene]-1,3-oxazol-5-one

Formula:C19H14NO2Br Mutagenic:none Tumorigenic:none Reproductive Effective:none (4E)-2-(2-bromophenyl)-4-[(Z)-2-methyl-3-phenylprop-2-enylidene]-1,3-oxazol-5-one is a drug-like molecule.

MolName	(4E)-2-(2-bromophenyl)-4-[(Z)-2-methyl-3-phenylprop-2-enylidene]-1,3-oxazol-5-one
MolecularFormula	C19H14NO2Br
Smiles	C/C(/C=C1/N=C(c(cccc2)c2Br)OC1=O)=C/c1ccccc1
InChI	InChI=1S/C19H14BrNO2/c1-13(11-14-7-3-2-4-8-14)12-17-19(22)23-18(21-17)15-9-5-6-10-16(15)20/h2-12H,1H3/b13-11-,17-12+
InChIK	YBLGMWFHZWMXAA-RTNVFWHRSA-N
TotalMolweight	368.229
Molweight	368.229
MonoisotopicMass	367.02079
CLogP	4.58
CLogS	-5.189
H Acceptors	3
TotalSurfaceArea	250.55
Relative PSA	0.1379
PolarSurfaceArea	38.66
Druglikeness	-0.63866
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6087
Fragments	1
Non HAtoms	23
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	2
StereoCon

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